N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide

C12H8Cl2N2O3 — CID 106685896

IUPACN-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide
SMILESNC(=O)c1ccc(Cl)c(NC(=O)c2ccoc2Cl)c1
InChIInChI=1S/C12H8Cl2N2O3/c13-8-2-1-6(11(15)17)5-9(8)16-12(18)7-3-4-19-10(7)14/h1-5H,(H2,15,17)(H,16,18)
InChIKeyFHVRNJZJQXTFHU-UHFFFAOYSA-N
MW299.11 g/mol
LogP2.94
Rot. Bonds3

About N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide

N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide (PubChem CID 106685896) has the molecular formula C12H8Cl2N2O3 and a molecular weight of 299.11 g/mol. Its IUPAC name is N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide.

Molecular Properties

Compound NameN-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide
PubChem CID106685896
Molecular FormulaC12H8Cl2N2O3
Molecular Weight299.11 g/mol
Exact Mass297.99
IUPAC NameN-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide
SMILESNC(=O)c1ccc(Cl)c(NC(=O)c2ccoc2Cl)c1
InChIInChI=1S/C12H8Cl2N2O3/c13-8-2-1-6(11(15)17)5-9(8)16-12(18)7-3-4-19-10(7)14/h1-5H,(H2,15,17)(H,16,18)
InChIKeyFHVRNJZJQXTFHU-UHFFFAOYSA-N
XLogP2.94
TPSA85.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.11
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-3-[(2-chlorofuran-3-carbonyl)amino]benzoic acid
CID 106683323
2-chloro-N-(2-chloro-5-methylsulfonylphenyl)furan-3-carboxamide
CID 106685589
N-(5-carbamoyl-2-chlorophenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 63939091
3-(carbamothioylamino)-4-chlorobenzamide
CID 86665570
methyl 3-[(2-bromofuran-3-carbonyl)amino]-4-chlorobenzoate
CID 106852836
2-chloro-N-[2-chloro-5-(4-hydroxybut-1-ynyl)phenyl]furan-3-carboxamide
CID 106688723
5-[(2-chlorofuran-3-carbonyl)amino]benzene-1,3-dicarboxylic acid
CID 106683355
3-[[4-(bromomethyl)benzoyl]amino]-4-chlorobenzamide
CID 102851094
2-chloro-N-(4-chloro-2-fluorophenyl)furan-3-carboxamide
CID 106685654
N-(2-amino-4-bromophenyl)-2-chlorofuran-3-carboxamide
CID 106683097
N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide
CID 106683261
5-chloro-2-[(2-chlorofuran-3-carbonyl)amino]benzoic acid
CID 106683314

Frequently Asked Questions

What is the IUPAC name of N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide?
The IUPAC name of N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide (CID 106685896) is N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide.
What is the SMILES notation for N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide?
The canonical SMILES for N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide is NC(=O)c1ccc(Cl)c(NC(=O)c2ccoc2Cl)c1.
What is the InChIKey of N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide?
The InChIKey is FHVRNJZJQXTFHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2N2O3/c13-8-2-1-6(11(15)17)5-9(8)16-12(18)7-3-4-19-10(7)14/h1-5H,(H2,15,17)(H,16,18).
What are the key properties of N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide?
N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide has a molecular weight of 299.11 g/mol, XLogP of 2.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide is sourced from PubChem (CID 106685896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).